Benzene-1,3-diol--benzene-1,3-diamine (1/1)
TL;DR: Benzene-1,3-diol--benzene-1,3-diamine (1/1) (CAS 51774-88-0) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-diamine;benzene-1,3-diol
Also Known As: benzene-1,3-diamine; benzene-1,3-diol, (C6-H8-N2.C6-H6-O2)x-, 1,3-Benzenediol, 1,3-benzene diamine polymer, 1,3-Benzenediol, polymer with 1,3-benzenediamine, Benzene-1,3-diol--benzene-1,3-diamine (1/1)
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 1.9488 |
| Topological Polar Surface Area | 92.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 380.27667 |
Chemical Identifiers
| CAS Number | 51774-88-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N)N.C1=CC(=CC(=C1)O)O |
Product Overview
Benzene-1,3-diol--benzene-1,3-diamine (1/1) (CAS 51774-88-0), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: benzene-1,3-diamine;benzene-1,3-diol.
Chemical Property Profile of Benzene-1,3-diol--benzene-1,3-diamine (1/1)
Property Insights of Benzene-1,3-diol--benzene-1,3-diamine (1/1)
The XLogP value of 1.9488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene-1,3-diol--benzene-1,3-diamine (1/1). The TPSA of 92.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene-1,3-diol--benzene-1,3-diamine (1/1). Following Lipinski's Rule of Five, Benzene-1,3-diol--benzene-1,3-diamine (1/1) has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene-1,3-diol--benzene-1,3-diamine (1/1)?
The CAS number of Benzene-1,3-diol--benzene-1,3-diamine (1/1) is 51774-88-0.
What is the molecular formula of Benzene-1,3-diol--benzene-1,3-diamine (1/1)?
The molecular formula of Benzene-1,3-diol--benzene-1,3-diamine (1/1) is C12H14N2O2.
What is the molecular weight of Benzene-1,3-diol--benzene-1,3-diamine (1/1)?
The molecular weight of Benzene-1,3-diol--benzene-1,3-diamine (1/1) is 218.11 g/mol.
Where can I buy Benzene-1,3-diol--benzene-1,3-diamine (1/1)?
You can request a quote for Benzene-1,3-diol--benzene-1,3-diamine (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene-1,3-diol--benzene-1,3-diamine (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Benzene-1,3-diol--benzene-1,3-diamine (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.